Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.44 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8632136 | 0.83 | ALDH1A1 (0.49) | EGFRPDGFRBPDGFRAKDRALOX5 | |
| SCHEMBL8659550 | 0.75 | POLB (0.50) | PKMALOX5ALDH1A1POLBTSHR | |
| SCHEMBL8748519 | 0.73 | CNR1 (0.49) | ALDH1A1TSHRKDM4EMAPTLMNA | |
| SCHEMBL20871233 | 0.73 | CA2 (0.61) | ALDH1A1POLBMAPK1TSHRKDM4E | |
| SCHEMBL8632559 | 0.72 | POLB (0.50) | PKMALOX5ALDH1A1POLBMAPK1 | |
| SCHEMBL8748288 | 0.70 | MAPT (0.55) | PKMALDH1A1POLBMAPK1TSHR | |
| SCHEMBL4094385 | 0.69 | L3MBTL1 (0.50) | PKMALDH1A1POLBMAPK1TSHR | |
| SCHEMBL6080143 | 0.68 | CYP1A2 (0.46) | ALDH1A1POLBMAPK1KDM4EMAPT | |
| SCHEMBL2815803 | 0.68 | MAPT (0.44) | PKMALOX5ALDH1A1POLBMAPK1 | |
| SCHEMBL8943682 | 0.66 | CA2 (0.58) | ALDH1A1POLBMAPK1TSHRKDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5709816-A | N,N-DISUBSTITUTED ANILINE COMPOUNDS | KAO CORPORATION (JP) | 1998-01-20 | — | — | US | disclosed |